CAS RN: 55824-11-8

Cannabigerovarol

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Batchno.20250514 1mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS55824-11-8
  • Purity/Analytical Methods: >99.0%
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55824-11-8 / 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-5-propylbenzene-1,3-diol

Standard CAS: 55824-11-8 Multi CAS: Yes

Basic Information

CAS
55824-11-8
Multi CAS
Yes
Molecular Formula
C19H28O2
Molecular Weight
288.400000
Exact Mass
288.208930
InChI
InChI=1S/C19H28O2/c1-5-7-16-12-18(20)17(19(21)13-16)11-10-15(4)9-6-8-14(2)3/h8,10,12-13,20-21H,5-7,9,11H2,1-4H3/b15-10+
InChIKey
YJYIDZLGVYOPGU-XNTDXEJSSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
6
Fraction Csp3
0.47
Rotatable bonds
7
H-bond acceptors
2
H-bond donors
2
Molar refractivity
89.89
TPSA
40.46

LogP / Solubility

WLOGP
5.29
MLOGP
4.66
XLogP3
6.3
Consensus LogP
5.42
Log S (ESOL)
-4.71
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.74
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.76
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.73

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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